21FP

Chloramphenicol-bound MexB

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-07-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9000
Spacegroup name	C 1 2 1
Unit cell lengths	204.874, 169.173, 171.926
Unit cell angles	90.00, 102.16, 90.00

Refinement procedure

Resolution	51.020 - 2.890
R-factor	0.2264
Rwork	0.224
R-free	0.27980
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.165
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	51.020	2.920
High resolution limit [Å]	2.890	2.890
Number of reflections	126964	3801
<I/σ(I)>	10.3
Completeness [%]	100.0
Redundancy	7.4
CC(1/2)	0.991	0.353

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	0.1 M HEPES pH8.0, 0.2 M KCl, 8% PEG4000